O-Phosphoviomycin

Molecular Formula: C25H44N13O13P


InChI: InChI=1/C25H44N13O13P/c26-3-1-2-10(27)4-16(40)32-12-6-30-23(46)18(11-5-17(41)37-24(28)36-11)38-20(43)13(7-31-25(29)47)33-21(44)14(8-39)34-22(45)15(35-19(12)42)9-51-52(48,49)50/h7,10-12,14-15,17-18,39,41H,1-6,8-9,26-27H2,(H,30,46)(H,32,40)(H,33,44)(H,34,45)(H,35,42)(H,38,43)(H3,28,36,37)(H3,29,31,47)(H2,48,49,50)/b13-7-/t10-,11+,12-,14-,15-,17-,18-/m0/s1/f/h30-36,38,48-49H,28-29H2

InChIKey: InChIKey=KFNFRHMHJQINPB-QVLZHRRJDB
SMILES: C1C(NC(=NC1O)N)C2C(=O)NCC(C(=O)NC(C(=O)NC(C(=O)NC(=CNC(=O)N)C(=O)N2)CO)COP(=O)(O)O)NC(=O)CC(CCCN)N

Names:
    C02574
    O-Phosphoviomycin
    [(2S,5S,8Z,11S,15S)-11-[(4R,6S)-2-amino-6-hydroxy-3,4,5,6-tetrahydropyrimidin-4-yl]-8-[(carbamoylamino)methylidene]-15-[[(3S)-3,6-diaminohexanoyl]amino]-5-(hydroxymethyl)-3,6,9,12,16-pentaoxo-1,4,7,10,13-pentazacyclohexadec-2-yl]methoxyphosphonic acid

Registries:
    PubChem CID 5280530
    PubChem ID 5569